2-[3-[bis(azanyl)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[3-[bis(azanyl)methylidene]-6-oxidanylidene-cyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-pyrrolidin-1-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[3-(diaminomethylene)-6-oxo-cyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-pyrrolidin-1-ylsulfonyl-phenyl)acetamide CAS Name: 2-[3-(diaminomethylidene)-6-oxo-1-cyclohexa-1,4-dienyl]-N-[3-methyl-4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[3-(diaminomethylidene)-6-oxocyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[3-(diaminomethylene)-6-keto-cyclohexa-1,4-dien-1-yl]-N-(3-methyl-4-pyrrolidinosulfonyl-phenyl)acetamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CC2=CC(=C(N)N)C=CC2=O)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CC2=CC(=C(N)N)C=CC2=O)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H24N4O4S/c1-13-10-16(5-7-18(13)29(27,28)24-8-2-3-9-24)23-19(26)12-15-11-14(20(21)22)4-6-17(15)25/h4-7,10-11H,2-3,8-9,12,21-22H2,1H3,(H,23,26)